[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone

C20H20N4O3 — CID 10406457

IUPAC[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone
SMILESCOc1ccc(-n2nc(C(=O)N3CCOCC3)cc2-c2ccccc2)cn1
InChIInChI=1S/C20H20N4O3/c1-26-19-8-7-16(14-21-19)24-18(15-5-3-2-4-6-15)13-17(22-24)20(25)23-9-11-27-12-10-23/h2-8,13-14H,9-12H2,1H3
InChIKeyQRRZWDUAIPFTPE-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.42
Rot. Bonds4

About [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone

[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone (PubChem CID 10406457) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone
PubChem CID10406457
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC Name[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone
SMILESCOc1ccc(-n2nc(C(=O)N3CCOCC3)cc2-c2ccccc2)cn1
InChIInChI=1S/C20H20N4O3/c1-26-19-8-7-16(14-21-19)24-18(15-5-3-2-4-6-15)13-17(22-24)20(25)23-9-11-27-12-10-23/h2-8,13-14H,9-12H2,1H3
InChIKeyQRRZWDUAIPFTPE-UHFFFAOYSA-N
XLogP2.42
TPSA69.48 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone (CID 10406457) is [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone is COc1ccc(-n2nc(C(=O)N3CCOCC3)cc2-c2ccccc2)cn1.
What is the InChIKey of [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone?
The InChIKey is QRRZWDUAIPFTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-26-19-8-7-16(14-21-19)24-18(15-5-3-2-4-6-15)13-17(22-24)20(25)23-9-11-27-12-10-23/h2-8,13-14H,9-12H2,1H3.
What are the key properties of [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone?
[1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone has a molecular weight of 364.41 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-methoxy-3-pyridinyl)-5-phenylpyrazol-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 10406457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).